2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole

C22H20N2 — CID 68573876

IUPAC2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole
SMILESc1ccc(CC2=NC(c3ccccc3)C(c3ccccc3)N2)cc1
InChIInChI=1S/C22H20N2/c1-4-10-17(11-5-1)16-20-23-21(18-12-6-2-7-13-18)22(24-20)19-14-8-3-9-15-19/h1-15,21-22H,16H2,(H,23,24)
InChIKeyLHTRHJABNRAZGV-UHFFFAOYSA-N
MW312.42 g/mol
LogP4.71
Rot. Bonds4

About 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole

2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole (PubChem CID 68573876) has the molecular formula C22H20N2 and a molecular weight of 312.42 g/mol. Its IUPAC name is 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole
PubChem CID68573876
Molecular FormulaC22H20N2
Molecular Weight312.42 g/mol
Exact Mass312.16
IUPAC Name2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole
SMILESc1ccc(CC2=NC(c3ccccc3)C(c3ccccc3)N2)cc1
InChIInChI=1S/C22H20N2/c1-4-10-17(11-5-1)16-20-23-21(18-12-6-2-7-13-18)22(24-20)19-14-8-3-9-15-19/h1-15,21-22H,16H2,(H,23,24)
InChIKeyLHTRHJABNRAZGV-UHFFFAOYSA-N
XLogP4.71
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole (CID 68573876) is 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole is c1ccc(CC2=NC(c3ccccc3)C(c3ccccc3)N2)cc1.
What is the InChIKey of 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole?
The InChIKey is LHTRHJABNRAZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2/c1-4-10-17(11-5-1)16-20-23-21(18-12-6-2-7-13-18)22(24-20)19-14-8-3-9-15-19/h1-15,21-22H,16H2,(H,23,24).
What are the key properties of 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole?
2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole has a molecular weight of 312.42 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 68573876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).